1-(6-methoxypyridazin-3-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-methoxypyridazin-3-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(6-methoxypyridazin-3-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-methoxy-3-pyridazinyl)-N-[3-(1-pyrrolidinylmethyl)phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-methoxypyridazin-3-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-methoxypyridazin-3-yl)-N-[3-(pyrrolidinomethyl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H21F3N6O2 MolecularWeight: 446.42565

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=CC(=C3)CN4CCCC4)C(F)(F)F

Isomeric SMILES

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC=CC(=C3)CN4CCCC4)C(F)(F)F

InChI

InChI=1S/C21H21F3N6O2/c1-32-18-8-7-17(27-28-18)30-19(21(22,23)24)16(12-25-30)20(31)26-15-6-4-5-14(11-15)13-29-9-2-3-10-29/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,26,31)